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Artigo de periodico
Stabilization mechanisms in the Li+3 cluster: a quantum Monte Carlo study of electron delocalization and correlation (2025)
Brito, Braulio Gabriel Alencar ; Cândido, Ladir ; Hai, Guo-Qiang
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: FÍSICA TEÓRICA, SISTEMA QUÂNTICO, MÉTODO DE MONTE CARLO
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BRITO, Braulio Gabriel Alencar e CÂNDIDO, Ladir e HAI, Guo-Qiang. Stabilization mechanisms in the Li+3 cluster: a quantum Monte Carlo study of electron delocalization and correlation. Journal of Chemical Physics, v. No 2025, n. 18, p. 184303-1-184303-7, 2025Tradução . . Disponível em: https://doi.org/10.1063/5.0289966. Acesso em: 24 nov. 2025.
APA
Brito, B. G. A., Cândido, L., & Hai, G. -Q. (2025). Stabilization mechanisms in the Li+3 cluster: a quantum Monte Carlo study of electron delocalization and correlation. Journal of Chemical Physics, No 2025( 18), 184303-1-184303-7. doi:10.1063/5.0289966
NLM
Brito BGA, Cândido L, Hai G-Q. Stabilization mechanisms in the Li+3 cluster: a quantum Monte Carlo study of electron delocalization and correlation [Internet]. Journal of Chemical Physics. 2025 ; No 2025( 18): 184303-1-184303-7.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0289966
Vancouver
Brito BGA, Cândido L, Hai G-Q. Stabilization mechanisms in the Li+3 cluster: a quantum Monte Carlo study of electron delocalization and correlation [Internet]. Journal of Chemical Physics. 2025 ; No 2025( 18): 184303-1-184303-7.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0289966
Artigo de periodico
Transient absorption and anisotropy studies of a push–pull azo derivative with an isomerization path-selective local minimum in the ground state (2025)
Garcia, Rafael de Queiroz ; Buckup, Tiago ; Ishow, Elena ; De Boni, Leonardo
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: LASER, ESPECTROSCOPIA DE ABSORÇÃO ATÔMICA, CONSERVAÇÃO DE ENERGIA
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GARCIA, Rafael de Queiroz et al. Transient absorption and anisotropy studies of a push–pull azo derivative with an isomerization path-selective local minimum in the ground state. Journal of Chemical Physics, v. 162, n. 12, p. 124305-1-124305-10 + supplementary material, 2025Tradução . . Disponível em: https://doi.org/10.1063/5.0251286. Acesso em: 24 nov. 2025.
APA
Garcia, R. de Q., Buckup, T., Ishow, E., & De Boni, L. (2025). Transient absorption and anisotropy studies of a push–pull azo derivative with an isomerization path-selective local minimum in the ground state. Journal of Chemical Physics, 162( 12), 124305-1-124305-10 + supplementary material. doi:10.1063/5.0251286
NLM
Garcia R de Q, Buckup T, Ishow E, De Boni L. Transient absorption and anisotropy studies of a push–pull azo derivative with an isomerization path-selective local minimum in the ground state [Internet]. Journal of Chemical Physics. 2025 ; 162( 12): 124305-1-124305-10 + supplementary material.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0251286
Vancouver
Garcia R de Q, Buckup T, Ishow E, De Boni L. Transient absorption and anisotropy studies of a push–pull azo derivative with an isomerization path-selective local minimum in the ground state [Internet]. Journal of Chemical Physics. 2025 ; 162( 12): 124305-1-124305-10 + supplementary material.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0251286
Artigo de periodico
Transition from a phosphate to niobate network structure in vitreous Nb2O5-NaPO3 (2025)
Salmon, Philip Stephen ; Lange, Esther Girón ; Zeidler, Anita ; Bradtmüller, Henrik ; Ensuncho Hernandez, Laureano Javier ; Cuello, Gabriel Julio ; Eckert, Hellmut
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: VIDRO CERÂMICO, RESSONÂNCIA MAGNÉTICA NUCLEAR, ESPECTROSCOPIA
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SALMON, Philip Stephen et al. Transition from a phosphate to niobate network structure in vitreous Nb2O5-NaPO3. Journal of Chemical Physics, v. 163, n. 14, p. 144510-1144510-17 + supplementary material, 2025Tradução . . Disponível em: https://doi.org/10.1063/5.0290349. Acesso em: 24 nov. 2025.
APA
Salmon, P. S., Lange, E. G., Zeidler, A., Bradtmüller, H., Ensuncho Hernandez, L. J., Cuello, G. J., & Eckert, H. (2025). Transition from a phosphate to niobate network structure in vitreous Nb2O5-NaPO3. Journal of Chemical Physics, 163( 14), 144510-1144510-17 + supplementary material. doi:10.1063/5.0290349
NLM
Salmon PS, Lange EG, Zeidler A, Bradtmüller H, Ensuncho Hernandez LJ, Cuello GJ, Eckert H. Transition from a phosphate to niobate network structure in vitreous Nb2O5-NaPO3 [Internet]. Journal of Chemical Physics. 2025 ; 163( 14): 144510-1144510-17 + supplementary material.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0290349
Vancouver
Salmon PS, Lange EG, Zeidler A, Bradtmüller H, Ensuncho Hernandez LJ, Cuello GJ, Eckert H. Transition from a phosphate to niobate network structure in vitreous Nb2O5-NaPO3 [Internet]. Journal of Chemical Physics. 2025 ; 163( 14): 144510-1144510-17 + supplementary material.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0290349
Artigo de periodico
Dynamic and relativistic effects on Pt–Pt indirect spin–spin coupling in aqueous solution studied by ab initio molecular dynamics and two- vs four-component density functional NMR calculations (2024)
Batista, Patrick Rodrigues ; Ducati, Lucas Colucci ; Autschbach, Jochen
Fonte: Journal of Chemical Physics. Unidade: IQ
Assuntos: RESSONÂNCIA MAGNÉTICA NUCLEAR, QUÍMICA QUÂNTICA
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BATISTA, Patrick Rodrigues e DUCATI, Lucas Colucci e AUTSCHBACH, Jochen. Dynamic and relativistic effects on Pt–Pt indirect spin–spin coupling in aqueous solution studied by ab initio molecular dynamics and two- vs four-component density functional NMR calculations. Journal of Chemical Physics, v. 160, p. 1-13 art. 114307, 2024Tradução . . Disponível em: https://dx.doi.org/10.1063/5.0196853. Acesso em: 24 nov. 2025.
APA
Batista, P. R., Ducati, L. C., & Autschbach, J. (2024). Dynamic and relativistic effects on Pt–Pt indirect spin–spin coupling in aqueous solution studied by ab initio molecular dynamics and two- vs four-component density functional NMR calculations. Journal of Chemical Physics, 160, 1-13 art. 114307. doi:10.1063/5.0196853
NLM
Batista PR, Ducati LC, Autschbach J. Dynamic and relativistic effects on Pt–Pt indirect spin–spin coupling in aqueous solution studied by ab initio molecular dynamics and two- vs four-component density functional NMR calculations [Internet]. Journal of Chemical Physics. 2024 ; 160 1-13 art. 114307.[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0196853
Vancouver
Batista PR, Ducati LC, Autschbach J. Dynamic and relativistic effects on Pt–Pt indirect spin–spin coupling in aqueous solution studied by ab initio molecular dynamics and two- vs four-component density functional NMR calculations [Internet]. Journal of Chemical Physics. 2024 ; 160 1-13 art. 114307.[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0196853
Artigo de periodico
On the mechanism for work function change of gold electrodes by ultrathin polyethyleneimine (PEI) films: effect of molecular order (2024)
Ferreira, Claudia Santana Gonçalves ; Sousa, Marcos da Silva ; Günther, Florian Steffen ; Miranda, Paulo Barbeitas
Fonte: Journal of Chemical Physics. Unidades: IFSC, EESC
Assuntos: SEMICONDUTORES (FÍSICO-QUÍMICA), FILMES FINOS, ESPECTROSCOPIA, POLÍMEROS (MATERIAIS), METAIS
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FERREIRA, Claudia Santana Gonçalves et al. On the mechanism for work function change of gold electrodes by ultrathin polyethyleneimine (PEI) films: effect of molecular order. Journal of Chemical Physics, v. No 2024, n. 17, p. 174709 -1-174709-13 + supplementary material, 2024Tradução . . Disponível em: https://doi.org/10.1063/5.0234654. Acesso em: 24 nov. 2025.
APA
Ferreira, C. S. G., Sousa, M. da S., Günther, F. S., & Miranda, P. B. (2024). On the mechanism for work function change of gold electrodes by ultrathin polyethyleneimine (PEI) films: effect of molecular order. Journal of Chemical Physics, No 2024( 17), 174709 -1-174709-13 + supplementary material. doi:10.1063/5.0234654
NLM
Ferreira CSG, Sousa M da S, Günther FS, Miranda PB. On the mechanism for work function change of gold electrodes by ultrathin polyethyleneimine (PEI) films: effect of molecular order [Internet]. Journal of Chemical Physics. 2024 ; No 2024( 17): 174709 -1-174709-13 + supplementary material.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0234654
Vancouver
Ferreira CSG, Sousa M da S, Günther FS, Miranda PB. On the mechanism for work function change of gold electrodes by ultrathin polyethyleneimine (PEI) films: effect of molecular order [Internet]. Journal of Chemical Physics. 2024 ; No 2024( 17): 174709 -1-174709-13 + supplementary material.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0234654
Artigo de periodico
Toward a numerically efficient description of bulk-solvated anionic states (2024)
Kiataki, Matheus Bacigalupo ; Coutinho, Kaline Rabelo ; Varella, Márcio Teixeira do Nascimento
Fonte: Journal of Chemical Physics. Unidade: IF
Assunto: MECÂNICA QUÂNTICA
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KIATAKI, Matheus Bacigalupo e COUTINHO, Kaline Rabelo e VARELLA, Márcio Teixeira do Nascimento. Toward a numerically efficient description of bulk-solvated anionic states. Journal of Chemical Physics, v. 161, n. 3, 2024Tradução . . Disponível em: https://doi.org/10.1063/5.0203247. Acesso em: 24 nov. 2025.
APA
Kiataki, M. B., Coutinho, K. R., & Varella, M. T. do N. (2024). Toward a numerically efficient description of bulk-solvated anionic states. Journal of Chemical Physics, 161( 3). doi:10.1063/5.0203247
NLM
Kiataki MB, Coutinho KR, Varella MT do N. Toward a numerically efficient description of bulk-solvated anionic states [Internet]. Journal of Chemical Physics. 2024 ; 161( 3):[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0203247
Vancouver
Kiataki MB, Coutinho KR, Varella MT do N. Toward a numerically efficient description of bulk-solvated anionic states [Internet]. Journal of Chemical Physics. 2024 ; 161( 3):[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0203247
Artigo de periodico
On a direct method of calculating pressure in the canonical ensemble (2024)
Tanouye, Fernando Takeshi ; Alves, Jozismar Rodrigues
Fonte: Journal of Chemical Physics. Unidade: IF
Assunto: MÉTODO DE MONTE CARLO
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TANOUYE, Fernando Takeshi e ALVES, Jozismar Rodrigues. On a direct method of calculating pressure in the canonical ensemble. Journal of Chemical Physics, v. 160, n. 6, 2024Tradução . . Disponível em: https://doi.org/10.1063/5.0187585. Acesso em: 24 nov. 2025.
APA
Tanouye, F. T., & Alves, J. R. (2024). On a direct method of calculating pressure in the canonical ensemble. Journal of Chemical Physics, 160( 6). doi:10.1063/5.0187585
NLM
Tanouye FT, Alves JR. On a direct method of calculating pressure in the canonical ensemble [Internet]. Journal of Chemical Physics. 2024 ; 160( 6):[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0187585
Vancouver
Tanouye FT, Alves JR. On a direct method of calculating pressure in the canonical ensemble [Internet]. Journal of Chemical Physics. 2024 ; 160( 6):[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0187585
Artigo de periodico
Magnetochiroptical nanocavities in hyperbolic metamaterials enable sensing down to the few-molecule level (2024)
Carvalho, William Orivaldo Faria ; Oliveira Junior, Osvaldo Novais de ; Mejía-Salazar, Jorge Ricardo
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: ELETROMAGNETISMO, FOTÔNICA, ÓPTICA ELETRÔNICA, POLÍMEROS (MATERIAIS), MATERIAIS NANOESTRUTURADOS
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CARVALHO, William Orivaldo Faria e OLIVEIRA JUNIOR, Osvaldo Novais de e MEJÍA-SALAZAR, Jorge Ricardo. Magnetochiroptical nanocavities in hyperbolic metamaterials enable sensing down to the few-molecule level. Journal of Chemical Physics, v. 160, n. 7, p. 071104-1-071104-6, 2024Tradução . . Disponível em: https://doi.org/10.1063/5.0183806. Acesso em: 24 nov. 2025.
APA
Carvalho, W. O. F., Oliveira Junior, O. N. de, & Mejía-Salazar, J. R. (2024). Magnetochiroptical nanocavities in hyperbolic metamaterials enable sensing down to the few-molecule level. Journal of Chemical Physics, 160( 7), 071104-1-071104-6. doi:10.1063/5.0183806
NLM
Carvalho WOF, Oliveira Junior ON de, Mejía-Salazar JR. Magnetochiroptical nanocavities in hyperbolic metamaterials enable sensing down to the few-molecule level [Internet]. Journal of Chemical Physics. 2024 ; 160( 7): 071104-1-071104-6.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0183806
Vancouver
Carvalho WOF, Oliveira Junior ON de, Mejía-Salazar JR. Magnetochiroptical nanocavities in hyperbolic metamaterials enable sensing down to the few-molecule level [Internet]. Journal of Chemical Physics. 2024 ; 160( 7): 071104-1-071104-6.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0183806
Artigo de periodico
Phase transitions of choline dihydrogen phosphate: a vibrational spectroscopy and periodic DFT study (2024)
Paschoal, Vitor Hugo ; Ribeiro, Mauro Carlos Costa
Fonte: Journal of Chemical Physics. Unidade: IQ
Assuntos: ESPECTROSCOPIA, HIDROGÊNIO
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PASCHOAL, Vitor Hugo e RIBEIRO, Mauro Carlos Costa. Phase transitions of choline dihydrogen phosphate: a vibrational spectroscopy and periodic DFT study. Journal of Chemical Physics, v. 160, p. 1-13 art. 094507 : + Supplementary materials (S1-S9), 2024Tradução . . Disponível em: https://dx.doi.org/10.1063/5.0189049. Acesso em: 24 nov. 2025.
APA
Paschoal, V. H., & Ribeiro, M. C. C. (2024). Phase transitions of choline dihydrogen phosphate: a vibrational spectroscopy and periodic DFT study. Journal of Chemical Physics, 160, 1-13 art. 094507 : + Supplementary materials (S1-S9). doi:10.1063/5.0189049
NLM
Paschoal VH, Ribeiro MCC. Phase transitions of choline dihydrogen phosphate: a vibrational spectroscopy and periodic DFT study [Internet]. Journal of Chemical Physics. 2024 ; 160 1-13 art. 094507 : + Supplementary materials (S1-S9).[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0189049
Vancouver
Paschoal VH, Ribeiro MCC. Phase transitions of choline dihydrogen phosphate: a vibrational spectroscopy and periodic DFT study [Internet]. Journal of Chemical Physics. 2024 ; 160 1-13 art. 094507 : + Supplementary materials (S1-S9).[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0189049
Artigo de periodico
Deeper-band electron contributions to stopping power of silicon for low-energy ions (2024)
Silva, Flávio Matias da ; Grande, Pedro Luis ; Koval, Natalia E. ; Shorto, Julian Marco Barbosa ; Silva, Tiago Fiorini da ; Arista, Nestor R.
Fonte: Journal of Chemical Physics. Unidades: IPEN, IF
Assuntos: FÍSICA NUCLEAR, RADIAÇÃO (ENERGIA RADIANTE)
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SILVA, Flávio Matias da et al. Deeper-band electron contributions to stopping power of silicon for low-energy ions. Journal of Chemical Physics, v. 161, n. 6, p. 064310, 2024Tradução . . Disponível em: https://dx.doi.org/10.1063/5.0218226. Acesso em: 24 nov. 2025.
APA
Silva, F. M. da, Grande, P. L., Koval, N. E., Shorto, J. M. B., Silva, T. F. da, & Arista, N. R. (2024). Deeper-band electron contributions to stopping power of silicon for low-energy ions. Journal of Chemical Physics, 161( 6), 064310. doi:10.1063/5.0218226
NLM
Silva FM da, Grande PL, Koval NE, Shorto JMB, Silva TF da, Arista NR. Deeper-band electron contributions to stopping power of silicon for low-energy ions [Internet]. Journal of Chemical Physics. 2024 ; 161( 6): 064310.[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0218226
Vancouver
Silva FM da, Grande PL, Koval NE, Shorto JMB, Silva TF da, Arista NR. Deeper-band electron contributions to stopping power of silicon for low-energy ions [Internet]. Journal of Chemical Physics. 2024 ; 161( 6): 064310.[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0218226
Artigo de periodico
Confined ionic liquids films under shear: the importance of the chemical nature of the solid surface (2023)
Bernardino, Kalil ; Ribeiro, Mauro Carlos Costa
Fonte: Journal of Chemical Physics. Unidade: IQ
Assuntos: FILMES FINOS, LÍQUIDOS IÔNICOS, CISALHAMENTO, VISCOSIDADE DO FLUXO DOS LÍQUIDOS
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BERNARDINO, Kalil e RIBEIRO, Mauro Carlos Costa. Confined ionic liquids films under shear: the importance of the chemical nature of the solid surface. Journal of Chemical Physics, v. 158, p. 1-15 art. 094712-2, 2023Tradução . . Disponível em: https://dx.doi.org/10.1063/5.0141388. Acesso em: 24 nov. 2025.
APA
Bernardino, K., & Ribeiro, M. C. C. (2023). Confined ionic liquids films under shear: the importance of the chemical nature of the solid surface. Journal of Chemical Physics, 158, 1-15 art. 094712-2. doi:10.1063/5.0141388
NLM
Bernardino K, Ribeiro MCC. Confined ionic liquids films under shear: the importance of the chemical nature of the solid surface [Internet]. Journal of Chemical Physics. 2023 ; 158 1-15 art. 094712-2.[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0141388
Vancouver
Bernardino K, Ribeiro MCC. Confined ionic liquids films under shear: the importance of the chemical nature of the solid surface [Internet]. Journal of Chemical Physics. 2023 ; 158 1-15 art. 094712-2.[citado 2025 nov. 24 ] Available from: https://dx.doi.org/10.1063/5.0141388
Artigo de periodico
Investigating the role of carbon doping on the structural and energetic properties of small aluminum clusters using quantum Monte Carlo (2023)
Brito, Bráulio Gabriel ; Hai, Guo-Qiang ; Cândido, Ladir
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: MÉTODO DE MONTE CARLO, FÍSICA MODERNA, PROPRIEDADES DOS MATERIAIS
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BRITO, Bráulio Gabriel e HAI, Guo-Qiang e CÂNDIDO, Ladir. Investigating the role of carbon doping on the structural and energetic properties of small aluminum clusters using quantum Monte Carlo. Journal of Chemical Physics, v. 158, n. 22, p. 224305-1-224305-7, 2023Tradução . . Disponível em: https://doi.org/10.1063/5.0156315. Acesso em: 24 nov. 2025.
APA
Brito, B. G., Hai, G. -Q., & Cândido, L. (2023). Investigating the role of carbon doping on the structural and energetic properties of small aluminum clusters using quantum Monte Carlo. Journal of Chemical Physics, 158( 22), 224305-1-224305-7. doi:10.1063/5.0156315
NLM
Brito BG, Hai G-Q, Cândido L. Investigating the role of carbon doping on the structural and energetic properties of small aluminum clusters using quantum Monte Carlo [Internet]. Journal of Chemical Physics. 2023 ; 158( 22): 224305-1-224305-7.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0156315
Vancouver
Brito BG, Hai G-Q, Cândido L. Investigating the role of carbon doping on the structural and energetic properties of small aluminum clusters using quantum Monte Carlo [Internet]. Journal of Chemical Physics. 2023 ; 158( 22): 224305-1-224305-7.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0156315
Artigo de periodico
Observation of the two-photon transition enhanced first hyperpolarizability spectra in cinnamaldehyde derivatives: a femtosecond regime study (2023)
Santos, Carlos Henrique Domingues dos; Cocca, Leandro Henrique Zucolotto ; Pelosi, André Gasparotto; Batista, Vasco Figueiredo; Pinto, Diana Cláudia Gouveia Alves; Faustino, Maria do Amparo Ferreira ; Vivas, Marcelo Gonçalves ; Siqueira, Jonathas de Paula ; Mendonça, Cleber Renato ; De Boni, Leonardo
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: ÓPTICA NÃO LINEAR, LASER, DISPOSITIVOS ELETRÔNICOS
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SANTOS, Carlos Henrique Domingues dos et al. Observation of the two-photon transition enhanced first hyperpolarizability spectra in cinnamaldehyde derivatives: a femtosecond regime study. Journal of Chemical Physics, v. 158, n. 21, p. 214201-1-214201-11 + supplementary materials, 2023Tradução . . Disponível em: https://doi.org/10.1063/5.0151622. Acesso em: 24 nov. 2025.
APA
Santos, C. H. D. dos, Cocca, L. H. Z., Pelosi, A. G., Batista, V. F., Pinto, D. C. G. A., Faustino, M. do A. F., et al. (2023). Observation of the two-photon transition enhanced first hyperpolarizability spectra in cinnamaldehyde derivatives: a femtosecond regime study. Journal of Chemical Physics, 158( 21), 214201-1-214201-11 + supplementary materials. doi:10.1063/5.0151622
NLM
Santos CHD dos, Cocca LHZ, Pelosi AG, Batista VF, Pinto DCGA, Faustino M do AF, Vivas MG, Siqueira J de P, Mendonça CR, De Boni L. Observation of the two-photon transition enhanced first hyperpolarizability spectra in cinnamaldehyde derivatives: a femtosecond regime study [Internet]. Journal of Chemical Physics. 2023 ; 158( 21): 214201-1-214201-11 + supplementary materials.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0151622
Vancouver
Santos CHD dos, Cocca LHZ, Pelosi AG, Batista VF, Pinto DCGA, Faustino M do AF, Vivas MG, Siqueira J de P, Mendonça CR, De Boni L. Observation of the two-photon transition enhanced first hyperpolarizability spectra in cinnamaldehyde derivatives: a femtosecond regime study [Internet]. Journal of Chemical Physics. 2023 ; 158( 21): 214201-1-214201-11 + supplementary materials.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0151622
Artigo de periodico
Studying the first order hyperpolarizability spectra in chalcone-based derivatives and the relation with one- and two-photon absorption transitions (2023)
Sciuti, Lucas Fiocco ; Santos, Carlos Henrique Domingues dos ; Cocca, Leandro Henrique Zucolotto ; Pelosi, André Gasparotto ; Costa, Rafaela Gomes Martins da ; Limberger, Jones ; Mendonça, Cleber Renato ; De Boni, Leonardo
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: ÓPTICA NÃO LINEAR, FOTÔNICA
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SCIUTI, Lucas Fiocco et al. Studying the first order hyperpolarizability spectra in chalcone-based derivatives and the relation with one- and two-photon absorption transitions. Journal of Chemical Physics, v. 159, n. 24, p. 244311-1-244311-9 + supplementary materials, 2023Tradução . . Disponível em: https://doi.org/10.1063/5.0166036. Acesso em: 24 nov. 2025.
APA
Sciuti, L. F., Santos, C. H. D. dos, Cocca, L. H. Z., Pelosi, A. G., Costa, R. G. M. da, Limberger, J., et al. (2023). Studying the first order hyperpolarizability spectra in chalcone-based derivatives and the relation with one- and two-photon absorption transitions. Journal of Chemical Physics, 159( 24), 244311-1-244311-9 + supplementary materials. doi:10.1063/5.0166036
NLM
Sciuti LF, Santos CHD dos, Cocca LHZ, Pelosi AG, Costa RGM da, Limberger J, Mendonça CR, De Boni L. Studying the first order hyperpolarizability spectra in chalcone-based derivatives and the relation with one- and two-photon absorption transitions [Internet]. Journal of Chemical Physics. 2023 ; 159( 24): 244311-1-244311-9 + supplementary materials.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0166036
Vancouver
Sciuti LF, Santos CHD dos, Cocca LHZ, Pelosi AG, Costa RGM da, Limberger J, Mendonça CR, De Boni L. Studying the first order hyperpolarizability spectra in chalcone-based derivatives and the relation with one- and two-photon absorption transitions [Internet]. Journal of Chemical Physics. 2023 ; 159( 24): 244311-1-244311-9 + supplementary materials.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0166036
Artigo de periodico
Structure of diopside, enstatite, and magnesium aluminosilicate glasses: a joint approach using neutron and x-ray diffraction and solid-state NMR (2022)
Mohammadi, Hesameddin ; Silva, Rita Mendes da ; Zeidler, Anita ; Gammond, Lawrence V. D. ; Gehlhaar, Florian ; Oliveira Junior, Marcos de ; Damasceno, Hugo ; Eckert, Hellmut ; Youngman, Randall E. ; Aitken, Bruce G.; Fischer, Henry E. ; Kohlmann, Holger ; Cormier, Laurent ; Benmore, Chris J. ; Salmon, Philip Stephen
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: RESSONÂNCIA MAGNÉTICA NUCLEAR, DIFRAÇÃO POR RAIOS X, VIDRO CERÂMICO
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ABNT
MOHAMMADI, Hesameddin et al. Structure of diopside, enstatite, and magnesium aluminosilicate glasses: a joint approach using neutron and x-ray diffraction and solid-state NMR. Journal of Chemical Physics, v. 157, n. 21, p. 214503-1-214503-22, 2022Tradução . . Disponível em: https://doi.org/10.1063/5.0125879. Acesso em: 24 nov. 2025.
APA
Mohammadi, H., Silva, R. M. da, Zeidler, A., Gammond, L. V. D., Gehlhaar, F., Oliveira Junior, M. de, et al. (2022). Structure of diopside, enstatite, and magnesium aluminosilicate glasses: a joint approach using neutron and x-ray diffraction and solid-state NMR. Journal of Chemical Physics, 157( 21), 214503-1-214503-22. doi:10.1063/5.0125879
NLM
Mohammadi H, Silva RM da, Zeidler A, Gammond LVD, Gehlhaar F, Oliveira Junior M de, Damasceno H, Eckert H, Youngman RE, Aitken BG, Fischer HE, Kohlmann H, Cormier L, Benmore CJ, Salmon PS. Structure of diopside, enstatite, and magnesium aluminosilicate glasses: a joint approach using neutron and x-ray diffraction and solid-state NMR [Internet]. Journal of Chemical Physics. 2022 ; 157( 21): 214503-1-214503-22.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0125879
Vancouver
Mohammadi H, Silva RM da, Zeidler A, Gammond LVD, Gehlhaar F, Oliveira Junior M de, Damasceno H, Eckert H, Youngman RE, Aitken BG, Fischer HE, Kohlmann H, Cormier L, Benmore CJ, Salmon PS. Structure of diopside, enstatite, and magnesium aluminosilicate glasses: a joint approach using neutron and x-ray diffraction and solid-state NMR [Internet]. Journal of Chemical Physics. 2022 ; 157( 21): 214503-1-214503-22.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0125879
Artigo de periodico
Structure of crystalline and amorphous materials in the NASICON system Na1+xAlxGe2-x(PO4)3 (2021)
Gammond, Lawrence V. D. ; Auer, Henry ; Silva, Rita Mendes da ; Zeidler, Anita ; Ortiz-Mosquera, Jairo F. ; Nieto-Muñoz, Adriana M. ; Rodrigues, Ana Candida M. ; Silva, Igor d'Anciães Almeida ; Eckert, Hellmut ; Benmore, Chris J. ; Salmon, Philip S.
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: ESPECTROSCOPIA DE RESSONÂNCIA MAGNÉTICA NUCLEAR, VIDRO CERÂMICO, MOBILIDADE IÔNICA
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ABNT
GAMMOND, Lawrence V. D. et al. Structure of crystalline and amorphous materials in the NASICON system Na1+xAlxGe2-x(PO4)3. Journal of Chemical Physics, v. 155, n. 7, p. 074501-1-074501-23 + supplementary material , 2021Tradução . . Disponível em: https://doi.org/10.1063/5.0049399. Acesso em: 24 nov. 2025.
APA
Gammond, L. V. D., Auer, H., Silva, R. M. da, Zeidler, A., Ortiz-Mosquera, J. F., Nieto-Muñoz, A. M., et al. (2021). Structure of crystalline and amorphous materials in the NASICON system Na1+xAlxGe2-x(PO4)3. Journal of Chemical Physics, 155( 7), 074501-1-074501-23 + supplementary material . doi:10.1063/5.0049399
NLM
Gammond LVD, Auer H, Silva RM da, Zeidler A, Ortiz-Mosquera JF, Nieto-Muñoz AM, Rodrigues ACM, Silva I d'AA, Eckert H, Benmore CJ, Salmon PS. Structure of crystalline and amorphous materials in the NASICON system Na1+xAlxGe2-x(PO4)3 [Internet]. Journal of Chemical Physics. 2021 ; 155( 7): 074501-1-074501-23 + supplementary material .[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0049399
Vancouver
Gammond LVD, Auer H, Silva RM da, Zeidler A, Ortiz-Mosquera JF, Nieto-Muñoz AM, Rodrigues ACM, Silva I d'AA, Eckert H, Benmore CJ, Salmon PS. Structure of crystalline and amorphous materials in the NASICON system Na1+xAlxGe2-x(PO4)3 [Internet]. Journal of Chemical Physics. 2021 ; 155( 7): 074501-1-074501-23 + supplementary material .[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0049399
Artigo de periodico
Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water (2021)
Oliveira, Leonardo Bruno Assis ; Fonseca, Tertius Lima ; Cabral, Benedito J C; Coutinho, Kaline Rabelo ; Canuto, Sylvio Roberto Accioly
Fonte: Journal of Chemical Physics. Unidade: IF
Assuntos: SOLVATAÇÃO, ÁGUA, METANOL
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ABNT
OLIVEIRA, Leonardo Bruno Assis et al. Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water. Journal of Chemical Physics, v. 155, 2021Tradução . . Disponível em: https://doi.org/10.1063/5.0065723. Acesso em: 24 nov. 2025.
APA
Oliveira, L. B. A., Fonseca, T. L., Cabral, B. J. C., Coutinho, K. R., & Canuto, S. R. A. (2021). Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water. Journal of Chemical Physics, 155. doi:10.1063/5.0065723
NLM
Oliveira LBA, Fonseca TL, Cabral BJC, Coutinho KR, Canuto SRA. Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water [Internet]. Journal of Chemical Physics. 2021 ; 155[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0065723
Vancouver
Oliveira LBA, Fonseca TL, Cabral BJC, Coutinho KR, Canuto SRA. Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water [Internet]. Journal of Chemical Physics. 2021 ; 155[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0065723
Artigo de periodico
Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution (2021)
Brandao, Idney ; Fonseca, Tertius ; Franco, Leandro ; Georg, Herbert C. ; Castro, Marcos
Fonte: Journal of Chemical Physics. Unidade: IF
Assuntos: FÍSICO-QUÍMICA, SOLVENTE, MECÂNICA QUÂNTICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
BRANDAO, Idney et al. Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution. Journal of Chemical Physics, v. 154, n. 9, 2021Tradução . . Disponível em: https://doi.org/10.1063/5.0033134. Acesso em: 24 nov. 2025.
APA
Brandao, I., Fonseca, T., Franco, L., Georg, H. C., & Castro, M. (2021). Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution. Journal of Chemical Physics, 154( 9). doi:10.1063/5.0033134
NLM
Brandao I, Fonseca T, Franco L, Georg HC, Castro M. Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution [Internet]. Journal of Chemical Physics. 2021 ; 154( 9):[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0033134
Vancouver
Brandao I, Fonseca T, Franco L, Georg HC, Castro M. Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution [Internet]. Journal of Chemical Physics. 2021 ; 154( 9):[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0033134
Artigo de periodico
Effect of alkyl-group flexibility on the melting point of imidazolium-based ionic liquids (2020)
Bernardino, Kalil ; Zhang, Yong; Ribeiro, Mauro Carlos Costa ; Maginn, Edward J
Fonte: Journal of Chemical Physics. Unidade: IQ
Assuntos: LÍQUIDOS IÔNICOS, ÍONS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
BERNARDINO, Kalil et al. Effect of alkyl-group flexibility on the melting point of imidazolium-based ionic liquids. Journal of Chemical Physics, v. 153, p. 1-14 art. 044504, 2020Tradução . . Disponível em: https://doi.org/10.1063/5.0015992. Acesso em: 24 nov. 2025.
APA
Bernardino, K., Zhang, Y., Ribeiro, M. C. C., & Maginn, E. J. (2020). Effect of alkyl-group flexibility on the melting point of imidazolium-based ionic liquids. Journal of Chemical Physics, 153, 1-14 art. 044504. doi:10.1063/5.0015992
NLM
Bernardino K, Zhang Y, Ribeiro MCC, Maginn EJ. Effect of alkyl-group flexibility on the melting point of imidazolium-based ionic liquids [Internet]. Journal of Chemical Physics. 2020 ; 153 1-14 art. 044504.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0015992
Vancouver
Bernardino K, Zhang Y, Ribeiro MCC, Maginn EJ. Effect of alkyl-group flexibility on the melting point of imidazolium-based ionic liquids [Internet]. Journal of Chemical Physics. 2020 ; 153 1-14 art. 044504.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/5.0015992
Artigo de periodico
Quantum Monte Carlo simulation for the many-body decomposition of the interaction energy and electron correlation of small superalkali lithium clusters (2019)
Brito, B. G. A.; Hai, Guo-Qiang ; Cândido, L.
Fonte: Journal of Chemical Physics. Unidade: IFSC
Assuntos: DIELÉTRICOS, MÉTODO DE MONTE CARLO, MATERIAIS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
BRITO, B. G. A. e HAI, Guo-Qiang e CÂNDIDO, L. Quantum Monte Carlo simulation for the many-body decomposition of the interaction energy and electron correlation of small superalkali lithium clusters. Journal of Chemical Physics, v. 151, n. 1, p. 014303-1-014303-8, 2019Tradução . . Disponível em: https://doi.org/10.1063/1.5099479. Acesso em: 24 nov. 2025.
APA
Brito, B. G. A., Hai, G. -Q., & Cândido, L. (2019). Quantum Monte Carlo simulation for the many-body decomposition of the interaction energy and electron correlation of small superalkali lithium clusters. Journal of Chemical Physics, 151( 1), 014303-1-014303-8. doi:10.1063/1.5099479
NLM
Brito BGA, Hai G-Q, Cândido L. Quantum Monte Carlo simulation for the many-body decomposition of the interaction energy and electron correlation of small superalkali lithium clusters [Internet]. Journal of Chemical Physics. 2019 ; 151( 1): 014303-1-014303-8.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/1.5099479
Vancouver
Brito BGA, Hai G-Q, Cândido L. Quantum Monte Carlo simulation for the many-body decomposition of the interaction energy and electron correlation of small superalkali lithium clusters [Internet]. Journal of Chemical Physics. 2019 ; 151( 1): 014303-1-014303-8.[citado 2025 nov. 24 ] Available from: https://doi.org/10.1063/1.5099479

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